Institute of Experimental Mineralogy
Russian Academy of Sciences
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142432, Chernogolovka, Moscow district
A.V. Chichagov +7(496)52-22320
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*** W W W - X R A Y P O L ***
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GANOMALITE
1
Pb(9)Ca(5)MnSi(9)O(33)
Hexagonal P 6(-) Z = 1
P6(-)
30 .5 .1908
Ref.Str.:
Dunn P.J., Peacor D.R., Valley J.W., Randall C.A. (1985)
* Mineral. Mag., 49, 579-582
Reserv:
from Franklin, New Jersey, and Jakobsberg, Sweden.
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 9.85 alpha = 90.0
b = 9.85 beta = 90.0
c = 10.13 gamma = 120.0
Unit cell volume (cub. angs.) = 851.16
Molar volume ( cub.cm/mol.) = 512.69
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.269 0.2697 0.1779 0.0 Pb = 1.00
2 0.2628 0.0096 0.5 0.0 Pb = 1.00
3 0.3333 0.6667 0.3382 0.0 Ca = 1.00
4 0.6667 0.3333 0.3195 0.0 Ca = 1.00
5 0.3333 0.6667 0.0 0.0 Ca = 1.00
6 0.6667 0.3333 0.0 0.0 Mn = 1.00
7 0.0257 0.4067 0.1497 0.0 Si = 1.00
8 0.4068 0.3883 0.5 0.0 Si = 1.00
9 0.0762 0.3079 0.2571 0.0 O = 1.00
10 0.1341 0.59 0.1675 0.0 O = 1.00
11 0.8391 0.3702 0.1513 0.0 O = 1.00
12 0.0737 0.3776 0.0 0.0 O = 1.00
13 0.3516 0.5028 0.5 0.0 O = 1.00
14 0.5945 0.4728 0.5 0.0 O = 1.00
15 0.3582 0.2644 0.3864 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.269 0.2697 0.1779
2 2 0.2628 0.0096 0.5
3 3 0.3333 0.6667 0.3382
4 4 0.6667 0.3333 0.3195
5 5 0.3333 0.6667 0.0
6 6 0.6667 0.3333 0.0
7 7 0.0257 0.4067 0.1497
8 8 0.4068 0.3883 0.5
9 9 0.0762 0.3079 0.2571
10 10 0.1341 0.59 0.1675
11 11 0.8391 0.3702 0.1513
12 12 0.0737 0.3776 0.0
13 13 0.3516 0.5028 0.5
14 14 0.5945 0.4728 0.5
15 15 0.3582 0.2644 0.3864
16 1 0.7303 0.9993 0.1779
17 1 0.0007 0.731 0.1779
18 2 0.9904 0.2532 0.5
19 2 0.7468 0.7372 0.5
20 7 0.5933 0.619 0.1497
21 7 0.381 0.9743 0.1497
22 8 0.6117 0.0185 0.5
23 8 0.9815 0.5932 0.5
24 9 0.6921 0.7683 0.2571
25 9 0.2317 0.9238 0.2571
26 10 0.41 0.5441 0.1675
27 10 0.4559 0.8659 0.1675
28 11 0.6298 0.4689 0.1513
29 11 0.5311 0.1609 0.1513
30 12 0.6224 0.6961 0.0
31 12 0.3039 0.9263 0.0
32 13 0.4972 0.8488 0.5
33 13 0.1512 0.6484 0.5
34 14 0.5272 0.1217 0.5
35 14 0.8783 0.4055 0.5
36 15 0.7356 0.0938 0.3864
37 15 0.9062 0.6418 0.3864
38 1 0.269 0.2697 0.8221
39 3 0.3333 0.6667 0.6618
40 4 0.6667 0.3333 0.6805
41 7 0.0257 0.4067 0.8503
42 9 0.0762 0.3079 0.7429
43 10 0.1341 0.59 0.8325
44 11 0.8391 0.3702 0.8487
45 15 0.3582 0.2644 0.6136
46 1 0.7303 0.9993 0.8221
47 1 0.0007 0.731 0.8221
48 7 0.5933 0.619 0.8503
49 7 0.381 0.9743 0.8503
50 9 0.6921 0.7683 0.7429
51 9 0.2317 0.9238 0.7429
52 10 0.41 0.5441 0.8325
53 10 0.4559 0.8659 0.8325
54 11 0.6298 0.4689 0.8487
55 11 0.5311 0.1609 0.8487
56 15 0.7356 0.0938 0.6136
57 15 0.9062 0.6418 0.6136
X-ray density (g/cm cub.) = 5.66
MU (1/cm) = 979.321 Mass attenuation coefficient (cm**2/g) = 173.101
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Pb 3.144 4
2.2597 9
2.2982 15
2.3433 10
3.0951 11
2 Pb 3.144 5
2.4795 15
2.5698 9
2.2641 14
2.4795 15
2.5698 9
3 Ca 2.88 6
2.4351 10
2.3695 13
2.4352 10
2.4351 10
2.3694 13
2.3694 13
4 Ca 2.88 9
2.3028 11
2.5908 14
2.8442 15
2.3028 11
2.3028 11
2.5908 14
2.5908 14
2.8442 15
2.8442 15
5 Ca 2.88 9
2.4121 10
2.714 12
2.4123 10
2.4122 10
2.7141 12
2.7139 12
2.4121 10
2.4123 10
2.4122 10
6 Mn 2.724 6
2.1792 11
2.1792 11
2.1792 11
2.1792 11
2.1792 11
2.1792 11
7 Si 2.1 4
1.6918 9
1.5826 10
1.6873 11
1.6556 12
8 Si 2.1 4
1.4768 13
1.6038 14
1.568 15
1.568 15
9 O 3.264 5
2.6992 10
2.9005 11
2.6966 12
3.0655 10
3.2161 15
10 O 3.264 6
2.6992 9
2.6204 11
2.523 12
3.0655 9
2.9697 10
2.9697 10
11 O 3.264 6
2.9005 9
2.6204 10
2.7433 12
2.6831 11
2.6831 11
3.0653 11
12 O 3.264 6
2.6966 9
2.523 10
2.7433 11
2.6966 9
2.523 10
2.7433 11
13 O 3.264 5
2.5532 14
2.6449 15
2.9637 13
2.9637 13
2.6449 15
14 O 3.264 7
2.5532 13
2.4855 15
3.1792 14
3.1792 14
2.9002 15
2.4855 15
2.9002 15
15 O 3.264 5
2.6449 13
2.4855 14
3.2161 9
2.9002 14
2.3015 15
X-ray diffraction powder data (II), X-Ray W.L. = 1.54056(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 0 0 1 4.361 8.722 0.049 342.92 2 25.3 60.8
2 1 0 0 5.181 10.362 0.059 242.3 6 57.7 668.8
3 1 0 1 6.78 13.559 0.077 140.55 12 30.3 213.5
4 0 0 2 8.747 17.495 0.099 83.54 2 43.6 43.9
5 1 1 0 8.998 17.996 0.102 78.83 6 253.8 4203.8
6 1 1 1 10.015 20.03 0.113 63.21 12 194.9 3978.6
7 1 0 2 10.187 20.375 0.115 61.02 12 22.0 49.1
8 2 0 0 10.405 20.809 0.117 58.41 6 201.5 1964.1
9 2 0 1 11.3 22.601 0.127 49.19 12 57.3 267.5
10 1 1 2 12.6 25.201 0.142 39.16 12 284.3 5242.0
11 0 0 3 13.186 26.373 0.148 35.58 2 678.7 4524.2
12 2 0 2 13.657 27.313 0.153 33.04 12 50.3 138.6
13 1 2 0 13.822 27.644 0.155 32.2 6 224.0 1338.5
14 2 1 0 13.822 27.644 0.155 32.2 6 257.2 1764.1
15 1 0 3 14.202 28.404 0.159 30.4 12 149.9 1131.5
16 1 2 1 14.52 29.04 0.163 28.99 12 248.8 2972.0
17 2 1 1 14.52 29.04 0.163 28.99 12 276.4 3668.9
18 3 0 0 15.718 31.435 0.176 24.46 6 449.4 4091.9
19 1 1 3 16.057 32.113 0.18 23.36 12 356.7 4922.8
20 3 0 1 16.342 32.683 0.183 22.49 12 33.4 41.5
21 1 2 2 16.452 32.903 0.184 22.16 12 270.7 2690.9
22 2 1 2 16.452 32.903 0.184 22.16 12 267.4 2625.8
23 2 0 3 16.915 33.83 0.189 20.87 12 61.4 130.1
24 0 0 4 17.708 35.415 0.197 18.88 2 102.1 54.3
25 3 0 2 18.099 36.199 0.202 18.0 12 58.6 102.5
26 2 2 0 18.228 36.457 0.203 17.72 6 171.3 430.7
27 1 0 4 18.498 36.997 0.206 17.16 12 42.0 50.2
28 2 2 1 18.779 37.557 0.209 16.6 12 54.4 81.4
29 1 3 0 19.001 38.001 0.211 16.17 6 258.4 894.0
30 3 1 0 19.001 38.001 0.211 16.17 6 151.9 309.2
31 1 2 3 19.289 38.577 0.214 15.64 12 184.7 883.7
32 2 1 3 19.289 38.577 0.214 15.64 12 133.9 464.6
33 1 3 1 19.532 39.065 0.217 15.21 12 85.7 185.1
34 3 1 1 19.532 39.065 0.217 15.21 12 29.3 21.6
35 1 1 4 20.0 39.999 0.222 14.44 12 190.1 863.7
36 2 2 2 20.354 40.707 0.226 13.88 12 86.3 171.2
37 2 0 4 20.716 41.432 0.23 13.35 12 60.3 80.5
38 3 0 3 20.741 41.483 0.23 13.31 12 196.7 853.3
39 1 3 2 21.06 42.12 0.233 12.86 12 104.4 232.1
40 3 1 2 21.06 42.12 0.233 12.86 12 40.5 35.0
41 4 0 0 21.174 42.347 0.234 12.71 6 422.6 1879.7
42 4 0 1 21.661 43.322 0.24 12.08 12 45.8 41.9
43 0 0 5 22.346 44.692 0.247 11.26 2 91.1 25.8
44 1 2 4 22.754 45.507 0.251 10.81 12 220.4 869.7
45 2 1 4 22.754 45.507 0.251 10.81 12 205.6 757.1
46 2 2 3 22.777 45.554 0.251 10.78 12 316.7 1791.7
47 1 0 5 23.003 46.005 0.254 10.55 12 29.3 15.0
48 4 0 2 23.073 46.146 0.254 10.47 12 45.3 35.7
49 2 3 0 23.179 46.358 0.255 10.37 6 304.5 796.2
50 3 2 0 23.179 46.358 0.255 10.37 6 200.6 345.3
51 1 3 3 23.424 46.849 0.258 10.12 12 240.9 973.2
52 3 1 3 23.424 46.849 0.258 10.12 12 265.6 1182.2
53 2 3 1 23.633 47.267 0.26 9.92 12 264.1 1145.8
54 3 2 1 23.633 47.267 0.26 9.92 12 213.1 746.0
55 3 0 4 24.036 48.071 0.264 9.55 12 42.6 28.7
56 1 1 5 24.275 48.549 0.267 9.33 12 321.9 1601.7
57 1 4 0 24.444 48.888 0.269 9.19 6 109.2 90.8
58 4 1 0 24.444 48.888 0.269 9.19 6 172.5 226.5
59 1 4 1 24.881 49.761 0.273 8.83 12 25.7 9.6
60 4 1 1 24.881 49.761 0.273 8.83 12 71.6 74.9
61 2 0 5 24.892 49.784 0.273 8.82 12 47.4 32.8
62 2 3 2 24.958 49.917 0.274 8.76 12 272.3 1075.9
63 3 2 2 24.958 49.917 0.274 8.76 12 247.4 888.2
64 4 0 3 25.29 50.58 0.277 8.5 12 488.8 3365.8
65 2 2 4 25.868 51.736 0.283 8.08 12 53.0 37.6
66 1 4 2 26.159 52.318 0.286 7.87 12 42.9 24.0
67 4 1 2 26.159 52.318 0.286 7.87 12 102.2 136.3
68 1 3 4 26.458 52.917 0.289 7.67 12 91.2 105.6
69 3 1 4 26.458 52.917 0.289 7.67 12 82.7 86.9
70 1 2 5 26.681 53.363 0.291 7.53 12 274.1 936.8
71 2 1 5 26.681 53.363 0.291 7.53 12 274.9 941.9
72 5 0 0 26.84 53.679 0.293 7.43 6 17.8 2.0
73 2 3 3 27.06 54.121 0.295 7.29 12 191.4 442.2
74 3 2 3 27.06 54.121 0.295 7.29 12 143.7 249.4
75 0 0 6 27.145 54.289 0.296 7.24 2 673.8 907.3
76 5 0 1 27.249 54.497 0.297 7.18 12 64.1 48.8
77 1 0 6 27.716 55.432 0.302 6.9 12 48.6 27.0
78 3 0 5 27.829 55.658 0.303 6.84 12 82.7 77.5
79 3 3 0 27.983 55.966 0.305 6.75 6 64.4 23.2
80 4 0 4 28.177 56.355 0.307 6.65 12 104.5 120.4
81 1 4 3 28.198 56.395 0.307 6.64 12 78.6 67.9
82 4 1 3 28.198 56.395 0.307 6.64 12 51.8 29.5
83 3 3 1 28.381 56.761 0.309 6.54 12 179.7 350.0
84 5 0 2 28.452 56.904 0.309 6.51 12 64.5 44.9
85 2 4 0 28.543 57.086 0.31 6.46 6 251.4 338.2
86 4 2 0 28.543 57.086 0.31 6.46 6 216.1 249.8
87 1 1 6 28.836 57.672 0.313 6.31 12 159.3 265.3
88 2 4 1 28.936 57.872 0.314 6.26 12 80.1 66.5
89 4 2 1 28.936 57.872 0.314 6.26 12 119.3 147.6
90 2 0 6 29.385 58.771 0.319 6.05 12 125.4 157.4
91 2 2 5 29.494 58.989 0.32 6.0 12 101.1 101.5
92 3 3 2 29.554 59.107 0.32 5.97 12 201.8 402.7
93 2 3 4 29.83 59.66 0.323 5.85 12 133.0 171.5
94 3 2 4 29.83 59.66 0.323 5.85 12 186.2 335.7
95 1 3 5 30.036 60.073 0.325 5.76 12 105.7 106.5
96 3 1 5 30.036 60.073 0.325 5.76 12 58.4 32.5
97 2 4 2 30.095 60.19 0.325 5.73 12 74.7 52.9
98 4 2 2 30.095 60.19 0.325 5.73 12 141.8 190.8
99 1 5 0 30.183 60.366 0.326 5.7 6 275.0 356.7
100 5 1 0 30.183 60.366 0.326 5.7 6 340.7 547.5
101 5 0 3 30.388 60.776 0.328 5.61 12 117.1 127.3
102 1 5 1 30.563 61.125 0.33 5.54 12 234.5 504.7
103 5 1 1 30.563 61.125 0.33 5.54 12 271.4 675.8
104 1 4 4 30.901 61.802 0.333 5.41 12 39.0 13.6
105 4 1 4 30.901 61.802 0.333 5.41 12 60.9 33.3
106 1 2 6 30.998 61.995 0.334 5.37 12 192.1 328.0
107 2 1 6 30.998 61.995 0.334 5.37 12 168.9 253.7
108 3 3 3 31.448 62.895 0.339 5.2 12 101.6 88.9
109 4 0 5 31.629 63.258 0.34 5.14 12 70.8 42.7
110 1 5 2 31.686 63.371 0.341 5.12 12 296.5 745.0
111 5 1 2 31.686 63.371 0.341 5.12 12 284.6 686.1
112 2 4 3 31.97 63.94 0.344 5.02 12 168.9 237.0
113 4 2 3 31.97 63.94 0.344 5.02 12 186.6 289.3
114 3 0 6 32.046 64.092 0.344 4.99 12 312.3 806.1
115 0 0 7 32.159 64.319 0.346 4.95 2 97.8 13.1
116 1 0 7 32.676 65.351 0.35 4.78 12 59.5 28.1
117 6 0 0 32.806 65.611 0.352 4.74 6 54.4 11.6
118 5 0 4 32.983 65.966 0.353 4.69 12 7.5 0.4
119 6 0 1 33.168 66.337 0.355 4.63 12 48.6 18.1
120 2 3 5 33.178 66.356 0.355 4.63 12 276.5 586.3
121 3 2 5 33.178 66.356 0.355 4.63 12 280.6 603.9
122 3 4 0 33.317 66.633 0.357 4.59 6 294.0 328.7
123 4 3 0 33.317 66.633 0.357 4.59 6 178.3 120.9
124 1 5 3 33.511 67.022 0.358 4.53 12 216.5 351.9
125 5 1 3 33.511 67.022 0.358 4.53 12 271.4 553.2
126 2 2 6 33.585 67.17 0.359 4.51 12 139.7 145.8
127 3 4 1 33.677 67.353 0.36 4.49 12 19.7 2.9
128 4 3 1 33.677 67.353 0.36 4.49 12 30.4 6.8
129 1 1 7 33.695 67.391 0.36 4.48 12 74.5 41.2
130 3 3 4 33.998 67.996 0.363 4.4 12 117.2 100.1
131 1 3 6 34.09 68.18 0.364 4.37 12 119.1 102.8
132 3 1 6 34.09 68.18 0.364 4.37 12 152.4 168.4
133 1 4 5 34.19 68.381 0.365 4.35 12 43.6 13.7
134 4 1 5 34.19 68.381 0.365 4.35 12 67.2 32.6
135 2 0 7 34.2 68.399 0.365 4.35 12 68.9 34.2
136 6 0 2 34.245 68.49 0.365 4.33 12 60.8 26.6
137 2 5 0 34.327 68.654 0.366 4.31 6 46.3 7.7
138 5 2 0 34.327 68.654 0.366 4.31 6 37.3 5.0
139 2 4 4 34.5 69.001 0.368 4.27 12 84.1 50.0
140 4 2 4 34.5 69.001 0.368 4.27 12 110.2 85.9
141 2 5 1 34.682 69.364 0.369 4.22 12 121.3 102.9
142 5 2 1 34.682 69.364 0.369 4.22 12 164.0 188.1
143 3 4 2 34.745 69.491 0.37 4.21 12 25.4 4.5
144 4 3 2 34.745 69.491 0.37 4.21 12 83.3 48.4
145 4 0 6 35.585 71.169 0.378 4.01 12 339.8 766.6
146 1 2 7 35.692 71.385 0.379 3.99 12 125.1 103.4
147 2 1 7 35.692 71.385 0.379 3.99 12 152.6 153.7
148 2 5 2 35.737 71.474 0.379 3.98 12 141.5 131.8
149 5 2 2 35.737 71.474 0.379 3.98 12 195.6 252.0
150 1 5 4 35.987 71.975 0.381 3.92 12 169.0 185.4
151 5 1 4 35.987 71.975 0.381 3.92 12 187.7 228.8
152 6 0 3 36.005 72.01 0.382 3.92 12 159.0 164.0
153 5 0 5 36.175 72.35 0.383 3.88 12 60.0 23.2
154 1 6 0 36.308 72.616 0.384 3.86 6 135.2 58.4
155 6 1 0 36.308 72.616 0.384 3.86 6 92.4 27.2
156 3 4 3 36.495 72.99 0.386 3.82 12 364.3 839.1
157 4 3 3 36.495 72.99 0.386 3.82 12 237.4 356.3
158 1 6 1 36.655 73.309 0.388 3.79 12 119.5 89.5
159 6 1 1 36.655 73.309 0.388 3.79 12 80.9 41.1
160 3 0 7 36.673 73.346 0.388 3.78 12 38.6 9.3
161 2 3 6 37.053 74.107 0.391 3.71 12 231.4 328.9
162 3 2 6 37.053 74.107 0.391 3.71 12 154.3 146.4
163 3 3 5 37.15 74.301 0.392 3.69 12 172.0 180.8
164 2 5 3 37.467 74.935 0.395 3.63 12 190.8 219.3
165 5 2 3 37.467 74.935 0.395 3.63 12 125.6 94.9
166 0 0 8 37.468 74.936 0.395 3.63 2 25.8 0.7
167 2 4 5 37.634 75.269 0.396 3.61 12 83.5 41.6
168 4 2 5 37.634 75.269 0.396 3.61 12 143.6 123.2
169 1 6 2 37.687 75.374 0.397 3.6 12 144.7 124.7
170 6 1 2 37.687 75.374 0.397 3.6 12 102.8 62.9
171 1 0 8 37.951 75.901 0.399 3.55 12 29.3 5.1
172 1 4 6 38.02 76.041 0.4 3.54 12 93.0 50.7
173 4 1 6 38.02 76.041 0.4 3.54 12 135.9 108.2
174 2 2 7 38.125 76.251 0.401 3.52 12 47.0 12.9
175 6 0 4 38.413 76.827 0.403 3.48 12 63.6 23.3
176 1 3 7 38.605 77.211 0.405 3.45 12 59.8 20.4
177 3 1 7 38.605 77.211 0.405 3.45 12 85.2 41.5
178 4 4 0 38.727 77.454 0.406 3.43 6 408.6 474.1
179 3 4 4 38.892 77.784 0.408 3.41 12 31.7 5.7
180 4 3 4 38.892 77.784 0.408 3.41 12 44.6 11.2
181 1 1 8 38.91 77.82 0.408 3.4 12 302.5 515.8
182 4 4 1 39.066 78.132 0.409 3.38 12 55.0 16.9
183 1 5 5 39.075 78.149 0.409 3.38 12 299.2 500.9
184 5 1 5 39.075 78.149 0.409 3.38 12 294.7 486.0
185 3 5 0 39.205 78.409 0.41 3.36 6 144.6 58.2
186 5 3 0 39.205 78.409 0.41 3.36 6 66.3 12.2
187 7 0 0 39.205 78.409 0.41 3.36 6 304.0 257.3
188 1 6 3 39.387 78.773 0.412 3.34 12 80.4 35.7
189 6 1 3 39.387 78.773 0.412 3.34 12 19.1 2.0
190 2 0 8 39.387 78.774 0.412 3.34 12 46.1 11.7
191 3 5 1 39.542 79.085 0.413 3.31 12 89.8 44.2
192 5 3 1 39.542 79.085 0.413 3.31 12 63.4 22.0
193 7 0 1 39.542 79.085 0.413 3.31 12 33.4 6.1
194 2 5 4 39.845 79.69 0.416 3.27 12 92.2 46.1
195 5 2 4 39.845 79.69 0.416 3.27 12 149.4 121.1
196 5 0 6 39.931 79.863 0.417 3.26 12 39.9 8.6
197 4 0 7 40.035 80.07 0.418 3.25 12 151.8 124.1
198 4 4 2 40.078 80.156 0.418 3.25 12 48.9 12.9
199 3 5 2 40.551 81.103 0.422 3.19 12 85.9 39.0
200 5 3 2 40.551 81.103 0.422 3.19 12 64.2 21.8
201 7 0 2 40.551 81.103 0.422 3.19 12 70.9 26.5
202 2 6 0 40.629 81.257 0.423 3.18 6 208.1 114.0
203 6 2 0 40.629 81.257 0.423 3.18 6 210.0 116.2
204 1 2 8 40.81 81.619 0.424 3.16 12 232.2 282.1
205 2 1 8 40.81 81.619 0.424 3.16 12 255.2 340.7
206 3 3 6 40.878 81.756 0.425 3.15 12 50.4 13.3
207 2 6 1 40.964 81.927 0.426 3.14 12 108.7 61.5
208 6 2 1 40.964 81.927 0.426 3.14 12 90.6 42.8
209 2 4 6 41.35 82.699 0.429 3.1 12 189.1 183.7
210 4 2 6 41.35 82.699 0.429 3.1 12 196.1 197.6
211 6 0 5 41.444 82.887 0.43 3.09 12 38.6 7.6
212 2 3 7 41.452 82.905 0.43 3.09 12 142.2 103.5
213 3 2 7 41.452 82.905 0.43 3.09 12 96.1 47.2
214 1 6 4 41.734 83.469 0.432 3.06 12 73.2 27.2
215 6 1 4 41.734 83.469 0.432 3.06 12 42.3 9.1
216 4 4 3 41.751 83.503 0.432 3.06 12 282.7 405.2
217 3 0 8 41.752 83.504 0.432 3.06 12 60.2 18.4
218 3 4 5 41.914 83.828 0.434 3.05 12 48.5 11.9
219 4 3 5 41.914 83.828 0.434 3.05 12 98.8 49.2
220 2 6 2 41.965 83.93 0.434 3.04 12 130.7 86.0
221 6 2 2 41.965 83.93 0.434 3.04 12 118.8 71.1
222 3 5 3 42.221 84.442 0.436 3.02 12 195.8 191.7
223 5 3 3 42.221 84.442 0.436 3.02 12 91.2 41.6
224 7 0 3 42.221 84.442 0.436 3.02 12 368.5 678.8
225 1 4 7 42.392 84.785 0.438 3.0 12 15.7 1.2
226 4 1 7 42.392 84.785 0.438 3.0 12 51.3 13.1
227 1 5 6 42.759 85.517 0.441 2.97 12 206.4 209.7
228 5 1 6 42.759 85.517 0.441 2.97 12 282.2 392.1
229 2 5 5 42.852 85.705 0.441 2.97 12 150.4 111.0
230 5 2 5 42.852 85.705 0.441 2.97 12 194.0 184.9
231 1 7 0 42.98 85.96 0.443 2.96 6 208.5 106.4
232 7 1 0 42.98 85.96 0.443 2.96 6 250.2 153.3
233 2 2 8 43.159 86.318 0.444 2.94 12 100.9 49.6
234 0 0 9 43.185 86.37 0.444 2.94 2 421.5 144.2
235 1 7 1 43.312 86.624 0.445 2.93 12 55.5 14.9
236 7 1 1 43.312 86.624 0.445 2.93 12 32.5 5.1
237 2 6 3 43.627 87.253 0.448 2.91 12 154.0 114.3
238 6 2 3 43.627 87.253 0.448 2.91 12 166.6 133.8
239 1 3 8 43.627 87.254 0.448 2.91 12 56.6 15.4
240 3 1 8 43.627 87.254 0.448 2.91 12 78.5 29.7
241 1 0 9 43.653 87.306 0.448 2.91 12 103.7 51.7
242 4 4 4 44.077 88.154 0.452 2.88 12 81.7 31.8
243 5 0 7 44.265 88.529 0.453 2.87 12 52.3 13.0
244 1 7 2 44.307 88.613 0.453 2.87 12 87.8 36.6
245 7 1 2 44.307 88.613 0.453 2.87 12 28.9 4.0
246 3 5 4 44.545 89.089 0.455 2.85 12 74.2 26.0
247 5 3 4 44.545 89.089 0.455 2.85 12 17.8 1.5
248 7 0 4 44.545 89.089 0.455 2.85 12 40.1 7.6
249 1 1 9 44.588 89.175 0.456 2.85 12 227.3 243.8
250 1 6 5 44.723 89.446 0.457 2.84 12 155.4 113.7
251 6 1 5 44.723 89.446 0.457 2.84 12 124.4 72.9
252 4 5 0 44.85 89.7 0.458 2.84 6 94.2 20.8
253 5 4 0 44.85 89.7 0.458 2.84 6 133.2 41.7
X-ray diffraction powder data (I)...X-Ray wave length = 1.54056 (angs.):
No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si)
( degree ) (angstrem) *100 *100
1 1 0 0 5.181 10.362 8.53035 668.8 10.1 10.2 5.6
2 1 0 1 6.78 13.559 6.52502 213.5 3.2 3.2 5.6
3 1 1 0 8.998 17.996 4.925 4203.8 63.3 63.8 5.6
4 1 1 1 10.015 20.03 4.42927 3978.6 59.9 60.3 5.6
5 2 0 0 10.405 20.809 4.26518 1964.1 29.6 29.8 5.6
6 2 0 1 11.3 22.601 3.93095 267.5 4.0 4.0 5.6
7 1 1 2 12.6 25.201 3.53096 5242.0 78.9 79.2 5.6
8 0 0 3 13.186 26.373 3.37667 4524.2 68.1 68.3 5.6
9 2 0 2 13.657 27.313 3.26251 138.6 2.1 2.1 5.6
10 2 1 0 13.822 27.644 3.22417 3102.7 46.7 46.8 5.6
11 1 0 3 14.202 28.404 3.13964 1131.5 17.0 17.0 5.6
12 2 1 1 14.52 29.04 3.07231 6640.9 100.0 100.0 5.6
13 3 0 0 15.718 31.435 2.84345 4091.9 61.6 61.5 5.6
14 1 1 3 16.057 32.113 2.78496 4922.8 74.1 73.9 5.6
15 1 2 2 16.452 32.903 2.71987 5316.7 80.1 79.8 5.6
16 2 0 3 16.915 33.83 2.64744 130.1 2.0 2.0 5.7
17 3 0 2 18.099 36.199 2.47945 102.5 1.5 1.5 5.7
18 2 2 0 18.228 36.457 2.4625 430.7 6.5 6.4 5.7
19 2 2 1 18.779 37.557 2.39282 81.4 1.2 1.2 5.7
20 1 3 0 19.001 38.001 2.36589 1203.2 18.1 18.0 5.7
21 1 2 3 19.289 38.577 2.33188 1348.3 20.3 20.1 5.7
22 1 3 1 19.532 39.065 2.30389 206.7 3.1 3.1 5.7
23 1 1 4 20.0 39.999 2.25219 863.7 13.0 12.9 5.7
24 2 2 2 20.354 40.707 2.21463 171.2 2.6 2.6 5.7
25 3 0 3 20.741 41.483 2.17501 933.7 14.1 13.9 5.7
26 1 3 2 21.06 42.12 2.14357 267.1 4.0 4.0 5.7
27 4 0 0 21.174 42.347 2.13259 1879.7 28.3 28.0 5.7
28 2 2 3 22.777 45.554 1.98962 3418.5 51.5 50.7 5.7
29 2 3 0 23.179 46.358 1.957 1141.5 17.2 16.9 5.7
30 3 1 3 23.424 46.849 1.93762 2155.4 32.5 31.9 5.7
31 2 3 1 23.633 47.267 1.92147 1891.8 28.5 28.0 5.7
32 1 1 5 24.275 48.549 1.87366 1601.7 24.1 23.7 5.7
33 4 1 0 24.444 48.888 1.86148 317.3 4.8 4.7 5.7
34 2 0 5 24.892 49.784 1.83003 117.3 1.8 1.7 5.7
35 2 3 2 24.958 49.917 1.82547 1964.1 29.6 29.0 5.7
36 4 0 3 25.29 50.58 1.80309 3365.8 50.7 49.6 5.8
37 4 1 2 26.159 52.318 1.74721 160.3 2.4 2.4 5.8
38 1 3 4 26.458 52.917 1.72884 192.5 2.9 2.8 5.8
39 2 1 5 26.681 53.363 1.71543 1878.7 28.3 27.6 5.8
40 2 3 3 27.06 54.121 1.69318 691.6 10.4 10.1 5.8
41 0 0 6 27.145 54.289 1.68833 907.3 13.7 13.3 5.8
42 3 0 5 27.829 55.658 1.65 77.5 1.2 1.1 5.8
43 4 0 4 28.177 56.355 1.63125 217.8 3.3 3.2 5.8
44 3 3 1 28.381 56.761 1.62052 350.0 5.3 5.1 5.8
45 2 4 0 28.543 57.086 1.61208 588.0 8.9 8.6 5.8
46 1 1 6 28.836 57.672 1.5971 265.3 4.0 3.9 5.8
47 4 2 1 28.936 57.872 1.59205 214.1 3.2 3.1 5.8
48 2 0 6 29.385 58.771 1.56982 157.4 2.4 2.3 5.8
49 2 2 5 29.494 58.989 1.56454 101.5 1.5 1.5 5.8
50 3 3 2 29.554 59.107 1.56168 402.7 6.1 5.9 5.8
51 3 2 4 29.83 59.66 1.54852 507.1 7.6 7.4 5.8
52 1 3 5 30.036 60.073 1.53887 139.0 2.1 2.0 5.8
53 4 2 2 30.095 60.19 1.53615 243.7 3.7 3.5 5.8
54 5 1 0 30.183 60.366 1.5321 904.2 13.6 13.1 5.8
55 5 0 3 30.388 60.776 1.52274 127.3 1.9 1.9 5.8
56 5 1 1 30.563 61.125 1.51487 1180.5 17.8 17.1 5.8
57 1 2 6 30.998 61.995 1.49568 581.7 8.8 8.4 5.8
58 3 3 3 31.448 62.895 1.47642 88.9 1.3 1.3 5.9
59 1 5 2 31.686 63.371 1.46647 1431.2 21.6 20.7 5.9
60 4 2 3 31.97 63.94 1.45479 526.3 7.9 7.6 5.9
61 3 0 6 32.046 64.092 1.45171 806.1 12.1 11.7 5.9
62 3 2 5 33.178 66.356 1.40757 1208.3 18.2 17.4 5.9
63 3 4 0 33.317 66.633 1.40238 449.6 6.8 6.5 5.9
64 5 1 3 33.511 67.022 1.3952 905.2 13.6 13.0 5.9
65 2 2 6 33.585 67.17 1.39248 145.8 2.2 2.1 5.9
66 3 3 4 33.998 67.996 1.37755 100.1 1.5 1.4 5.9
67 3 1 6 34.09 68.18 1.37429 271.1 4.1 3.9 5.9
68 2 0 7 34.2 68.399 1.37041 80.4 1.2 1.2 5.9
69 4 2 4 34.5 69.001 1.35993 135.9 2.0 1.9 5.9
70 5 2 1 34.682 69.364 1.3537 290.9 4.4 4.2 5.9
71 4 0 6 35.585 71.169 1.32372 766.6 11.5 11.0 5.9
72 2 1 7 35.692 71.385 1.32025 257.1 3.9 3.7 5.9
73 5 2 2 35.737 71.474 1.31883 383.8 5.8 5.5 5.9
74 5 1 4 35.987 71.975 1.31088 578.3 8.7 8.2 5.9
75 1 6 0 36.308 72.616 1.30087 85.6 1.3 1.2 6.0
76 3 4 3 36.495 72.99 1.29513 1195.4 18.0 17.0 6.0
77 1 6 1 36.655 73.309 1.29027 139.9 2.1 2.0 6.0
78 2 3 6 37.053 74.107 1.27835 475.3 7.2 6.8 6.0
79 3 3 5 37.15 74.301 1.27549 180.8 2.7 2.6 6.0
80 2 5 3 37.467 74.935 1.26627 314.9 4.7 4.5 6.0
81 4 2 5 37.634 75.269 1.26147 164.8 2.5 2.3 6.0
82 1 6 2 37.687 75.374 1.25997 187.6 2.8 2.7 6.0
83 4 1 6 38.02 76.041 1.25057 158.9 2.4 2.2 6.0
84 4 4 0 38.727 77.454 1.23125 474.1 7.1 6.7 6.0
85 1 1 8 38.91 77.82 1.22636 532.7 8.0 7.5 6.0
86 5 1 5 39.075 78.149 1.22202 1003.8 15.1 14.1 6.0
87 7 0 0 39.205 78.409 1.21862 327.7 4.9 4.6 6.0
88 3 5 1 39.542 79.085 1.2099 72.4 1.1 1.0 6.0
89 5 2 4 39.845 79.69 1.20222 167.2 2.5 2.3 6.0
90 4 0 7 40.035 80.07 1.19747 124.1 1.9 1.7 6.0
91 3 5 2 40.551 81.103 1.18481 87.3 1.3 1.2 6.1
92 6 2 0 40.629 81.257 1.18295 230.2 3.5 3.2 6.1
93 2 1 8 40.81 81.619 1.17861 622.8 9.4 8.7 6.1
94 2 6 1 40.964 81.927 1.17496 104.3 1.6 1.5 6.1
95 4 2 6 41.35 82.699 1.16594 381.3 5.7 5.3 6.1
96 3 2 7 41.452 82.905 1.16357 158.4 2.4 2.2 6.1
97 4 4 3 41.751 83.503 1.15675 459.8 6.9 6.4 6.1
98 2 6 2 41.965 83.93 1.15195 157.1 2.4 2.2 6.1
99 7 0 3 42.221 84.442 1.14626 912.1 13.7 12.7 6.1
100 5 1 6 42.759 85.517 1.13458 601.9 9.1 8.3 6.1
101 5 2 5 42.852 85.705 1.13258 296.0 4.5 4.1 6.1
102 7 1 0 42.98 85.96 1.12987 259.7 3.9 3.6 6.1
103 0 0 9 43.185 86.37 1.12556 193.8 2.9 2.7 6.1
104 6 2 3 43.627 87.253 1.11642 345.0 5.2 4.8 6.2
105 1 1 9 44.588 89.175 1.09727 243.8 3.7 3.3 6.2
106 1 6 5 44.723 89.446 1.09464 186.5 2.8 2.6 6.2
Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)
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